Geometry & MOs

Info

ID:	273716
PubChem CID:	103799370
Reduced:	ClNO4C14H20 (1)
Stoich.:	ABC4D14E20 (1)
Weight, g/mol:	315.04701
ΔH_f, kcal/mol:	-168.0
Dipole, Da:	2.52
IP(EA), eV:	-9.21(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)-2-methylbenzamide

Drug info:

PubChemData

Smile

CC(C(=O)NC(CCO)COC)OC1=CC=CC=C1Cl

DOS

IR

Vibrations